[(2S)-1-(4-methanoylpiperazin-1-yl)-1-oxidanylidene-3-phenyl-propan-2-yl]azanium

Systemtic Name: [(2S)-1-(4-methanoylpiperazin-1-yl)-1-oxidanylidene-3-phenyl-propan-2-yl]azanium Openeye Name: [(1S)-1-benzyl-2-(4-formylpiperazin-1-yl)-2-oxo-ethyl]ammonium CAS Name: [(2S)-1-(4-formyl-1-piperazinyl)-1-oxo-3-phenylpropan-2-yl]ammonium IUPAC Name: [(2S)-1-(4-formylpiperazin-1-yl)-1-oxo-3-phenylpropan-2-yl]azanium Traditional Name: [(1S)-1-benzyl-2-(4-formylpiperazino)-2-keto-ethyl]ammonium Formula: C14H20N3O2+ MolecularWeight: 262.3275

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C=O)C(=O)C(CC2=CC=CC=C2)[NH3+]

Isomeric SMILES

C1CN(CCN1C=O)C(=O)[C@H](CC2=CC=CC=C2)[NH3+]

InChI

InChI=1S/C14H19N3O2/c15-13(10-12-4-2-1-3-5-12)14(19)17-8-6-16(11-18)7-9-17/h1-5,11,13H,6-10,15H2/p+1/t13-/m0/s1